Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hta_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 ASP 13.A OD1 no hydrogen 3.200 N/A ARG 4.A NH1 ASP 13.A OD2 no hydrogen 2.811 N/A SER 6.A N PRO 3.A O no hydrogen 3.329 N/A HIS 12.A N PRO 9.A O no hydrogen 2.985 N/A ASP 13.A N ARG 10.A O no hydrogen 3.328 N/A GLU 15.A N ASP 13.A OD2 no hydrogen 2.978 N/A ARG 16.A N ASP 13.A O no hydrogen 3.099 N/A ARG 16.A N ASP 13.A OD2 no hydrogen 3.177 N/A ARG 16.A NE SER 51.A OG no hydrogen 3.343 N/A ARG 17.A N ASP 13.A O no hydrogen 3.358 N/A GLN 18.A N PRO 14.A O no hydrogen 2.951 N/A GLN 18.A NE2 ASP 22.A OD2 no hydrogen 2.707 N/A GLN 18.A NE2 GLN 69.A OE1 no hydrogen 2.783 N/A ARG 19.A N GLU 15.A O no hydrogen 3.146 N/A ILE 20.A N ARG 16.A O no hydrogen 3.164 N/A ILE 21.A N ARG 17.A O no hydrogen 3.188 N/A ASP 22.A N GLN 18.A O no hydrogen 2.903 N/A ALA 23.A N ARG 19.A O no hydrogen 2.994 N/A ALA 24.A N ILE 20.A O no hydrogen 2.824 N/A ILE 25.A N ILE 21.A O no hydrogen 3.045 N/A ARG 26.A N ASP 22.A O no hydrogen 3.149 N/A ARG 26.A NH1 GLU 44.A O no hydrogen 3.039 N/A ARG 26.A NH1 GLU 44.A OE2 no hydrogen 3.074 N/A VAL 27.A N ALA 23.A O no hydrogen 3.028 N/A VAL 28.A N ALA 24.A O no hydrogen 2.928 N/A GLY 29.A N ILE 25.A O no hydrogen 2.967 N/A GLN 30.A N ARG 26.A O no hydrogen 3.005 N/A LYS 31.A N VAL 27.A O no hydrogen 2.878 N/A LYS 31.A NZ GLY 35.A O no hydrogen 2.580 N/A ILE 33.A N GLU 115.A OE1 no hydrogen 3.198 N/A GLY 35.A N GLY 32.A O no hydrogen 2.855 N/A LEU 36.A N ILE 33.A O no hydrogen 3.196 N/A SER 37.A N THR 40.A OG1 no hydrogen 3.122 N/A HIS 38.A NE2 PHE 56.A O no hydrogen 2.733 N/A THR 40.A N SER 37.A OG no hydrogen 3.203 N/A THR 40.A OG1 GLY 35.A O no hydrogen 2.757 N/A THR 40.A OG1 SER 37.A O no hydrogen 3.311 N/A VAL 41.A N SER 37.A O no hydrogen 2.891 N/A ALA 42.A N HIS 38.A O no hydrogen 2.814 N/A ALA 43.A N ARG 39.A O no hydrogen 3.280 N/A GLU 44.A N THR 40.A O no hydrogen 2.946 N/A ALA 45.A N VAL 41.A O no hydrogen 2.861 N/A ASP 46.A N ALA 43.A O no hydrogen 3.079 N/A VAL 47.A N ALA 42.A O no hydrogen 3.014 N/A SER 51.A N PRO 48.A O no hydrogen 3.043 N/A THR 52.A N LEU 49.A O no hydrogen 2.900 N/A THR 52.A OG1 LEU 49.A O no hydrogen 2.761 N/A THR 53.A N LEU 49.A O no hydrogen 3.207 N/A THR 53.A OG1 LEU 49.A O no hydrogen 3.536 N/A THR 53.A OG1 GLY 50.A O no hydrogen 2.879 N/A TYR 54.A N GLY 50.A O no hydrogen 3.006 N/A HIS 55.A N SER 51.A O no hydrogen 3.462 N/A HIS 55.A NE2 ARG 11.A O no hydrogen 2.908 N/A PHE 56.A N THR 52.A O no hydrogen 2.772 N/A THR 58.A N ASP 61.A OD2 no hydrogen 3.408 N/A THR 58.A OG1 ASP 61.A OD2 no hydrogen 2.795 N/A ASP 61.A N THR 58.A OG1 no hydrogen 3.356 N/A LEU 62.A N THR 58.A O no hydrogen 3.301 N/A MET 63.A N LEU 59.A O no hydrogen 2.854 N/A VAL 64.A N ASP 60.A O no hydrogen 2.765 N/A ALA 65.A N ASP 61.A O no hydrogen 3.175 N/A ALA 66.A N LEU 62.A O no hydrogen 2.936 N/A LEU 67.A N MET 63.A O no hydrogen 2.789 N/A ARG 68.A N VAL 64.A O no hydrogen 3.039 N/A ARG 68.A NH1 GLU 132.A OE1 no hydrogen 3.369 N/A ARG 68.A NH1 GLU 132.A OE2 no hydrogen 2.729 N/A GLN 69.A N ALA 65.A O no hydrogen 3.257 N/A ALA 70.A N ALA 66.A O no hydrogen 2.904 N/A ASN 71.A N LEU 67.A O no hydrogen 2.836 N/A GLU 72.A N GLN 69.A O no hydrogen 3.136 N/A GLY 73.A N ALA 70.A O no hydrogen 2.863 N/A ALA 75.A N ASN 71.A O no hydrogen 3.113 N/A ARG 76.A N GLU 72.A O no hydrogen 3.145 N/A VAL 77.A N PHE 74.A O no hydrogen 3.074 N/A VAL 78.A N PHE 74.A O no hydrogen 3.143 N/A ALA 79.A N ALA 75.A O no hydrogen 2.900 N/A ALA 80.A N ARG 76.A O no hydrogen 3.140 N/A ALA 80.A N VAL 77.A O no hydrogen 3.290 N/A HIS 81.A N VAL 78.A O no hydrogen 2.869 N/A HIS 81.A ND1 GLU 94.A OE2 no hydrogen 2.824 N/A HIS 81.A NE2 GLU 101.A OE1 no hydrogen 2.962 N/A HIS 81.A NE2 GLU 101.A OE2 no hydrogen 3.115 N/A LEU 84.A N HIS 81.A O no hydrogen 3.068 N/A SER 85.A N PRO 82.A O no hydrogen 3.046 N/A SER 85.A OG PRO 82.A O no hydrogen 2.971 N/A GLU 88.A N ASP 86.A OD1 no hydrogen 2.600 N/A ALA 89.A N ASP 86.A O no hydrogen 2.961 N/A SER 92.A OG THR 181.A OG1 no hydrogen 3.416 N/A GLY 93.A N ASP 90.A OD1 no hydrogen 3.363 N/A GLU 94.A N ASP 90.A O no hydrogen 3.028 N/A LEU 95.A N LEU 91.A O no hydrogen 2.774 N/A ALA 96.A N SER 92.A O no hydrogen 2.959 N/A ARG 97.A N GLY 93.A O no hydrogen 2.980 N/A ARG 97.A NH1 GLU 173.A OE1 no hydrogen 2.784 N/A VAL 98.A N GLU 94.A O no hydrogen 2.921 N/A LEU 99.A N LEU 95.A O no hydrogen 3.162 N/A GLY 100.A N ALA 96.A O no hydrogen 3.100 N/A GLU 101.A N ARG 97.A O no hydrogen 3.114 N/A TRP 102.A N VAL 98.A O no hydrogen 3.031 N/A TRP 102.A NE1 GLU 113.A OE1 no hydrogen 2.954 N/A LEU 103.A N LEU 99.A O no hydrogen 2.763 N/A GLY 104.A N GLY 100.A O no hydrogen 2.928 N/A GLY 105.A N TRP 102.A O no hydrogen 3.032 N/A ARG 107.A NE LEU 103.A O no hydrogen 3.351 N/A ARG 107.A NH1 LEU 103.A O no hydrogen 3.330 N/A THR 108.A N ASP 106.A OD1 no hydrogen 2.967 N/A GLY 109.A N ASP 106.A O no hydrogen 2.962 N/A GLY 109.A N ASP 106.A OD1 no hydrogen 3.265 N/A VAL 110.A N ASP 106.A O no hydrogen 3.208 N/A GLU 111.A N ARG 107.A O no hydrogen 2.823 N/A LEU 112.A N THR 108.A O no hydrogen 3.087 N/A GLU 113.A N GLY 109.A O no hydrogen 2.933 N/A TYR 114.A N VAL 110.A O no hydrogen 2.905 N/A TYR 114.A OH ASP 158.A OD1 no hydrogen 2.444 N/A GLU 115.A N GLU 111.A O no hydrogen 2.715 N/A LEU 116.A N LEU 112.A O no hydrogen 3.051 N/A TYR 117.A N GLU 113.A O no hydrogen 3.203 N/A TYR 117.A OH ASP 158.A OD2 no hydrogen 2.722 N/A LEU 118.A N TYR 114.A O no hydrogen 2.808 N/A ALA 119.A N GLU 115.A O no hydrogen 3.001 N/A ALA 119.A N LEU 116.A O no hydrogen 3.355 N/A ALA 120.A N TYR 117.A O no hydrogen 3.466 N/A LEU 121.A N LEU 118.A O no hydrogen 2.988 N/A LEU 126.A N ARG 123.A O no hydrogen 2.934 N/A ARG 127.A N PRO 124.A O no hydrogen 3.367 N/A ARG 127.A NE ALA 120.A O no hydrogen 3.160 N/A ARG 127.A NH2 LEU 121.A O no hydrogen 2.704 N/A ALA 130.A N LEU 126.A O no hydrogen 3.046 N/A ALA 131.A N ARG 127.A O no hydrogen 2.783 N/A GLU 132.A N PRO 128.A O no hydrogen 2.977 N/A TRP 133.A N VAL 129.A O no hydrogen 3.044 N/A ALA 134.A N ALA 130.A O no hydrogen 2.866 N/A GLU 135.A N ALA 131.A O no hydrogen 2.962 N/A GLY 136.A N GLU 132.A O no hydrogen 2.881 N/A VAL 137.A N TRP 133.A O no hydrogen 2.837 N/A GLY 138.A N ALA 134.A O no hydrogen 2.878 N/A ALA 139.A N GLU 135.A O no hydrogen 2.887 N/A LEU 140.A N VAL 137.A O no hydrogen 2.992 N/A LEU 141.A N GLY 138.A O no hydrogen 2.806 N/A ARG 144.A NH1 ALA 89.A O no hydrogen 3.449 N/A THR 145.A N ALA 142.A O no hydrogen 3.111 N/A THR 145.A OG1 LEU 141.A O no hydrogen 2.558 N/A THR 145.A OG1 ALA 142.A O no hydrogen 3.500 N/A THR 149.A N ASP 146.A OD1 no hydrogen 3.095 N/A THR 149.A OG1 ASP 146.A OD1 no hydrogen 2.664 N/A THR 149.A OG1 ASP 146.A OD2 no hydrogen 2.357 N/A ALA 150.A N ASP 146.A O no hydrogen 2.813 N/A ARG 151.A N PRO 147.A O no hydrogen 2.885 N/A ALA 152.A N THR 148.A O no hydrogen 3.031 N/A LEU 153.A N THR 149.A O no hydrogen 3.131 N/A VAL 156.A N ALA 152.A O no hydrogen 2.990 N/A LEU 157.A N LEU 153.A O no hydrogen 2.924 N/A ASP 158.A N VAL 154.A O no hydrogen 2.583 N/A GLY 159.A N ALA 155.A O no hydrogen 2.937 N/A ILE 160.A N VAL 156.A O no hydrogen 3.126 N/A CYS 161.A N LEU 157.A O no hydrogen 3.140 N/A CYS 161.A SG LEU 157.A O no hydrogen 3.568 N/A LEU 162.A N ASP 158.A O no hydrogen 2.710 N/A GLN 163.A N GLY 159.A O no hydrogen 2.882 N/A VAL 164.A N ILE 160.A O no hydrogen 3.264 N/A VAL 164.A N CYS 161.A O no hydrogen 2.934 N/A LEU 165.A N CYS 161.A O no hydrogen 2.804 N/A LEU 166.A N LEU 162.A O no hydrogen 3.096 N/A THR 167.A OG1 GLN 163.A O no hydrogen 2.892 N/A THR 167.A OG1 THR 169.A OG1 no hydrogen 2.716 N/A THR 169.A N VAL 164.A O no hydrogen 3.372 N/A THR 169.A OG1 THR 167.A OG1 no hydrogen 2.716 N/A TYR 171.A OH ALA 96.A O no hydrogen 2.687 N/A TYR 175.A N ASP 172.A OD1 no hydrogen 2.940 N/A TYR 175.A OH GLN 163.A OE1 no hydrogen 3.181 N/A ALA 176.A N ASP 172.A O no hydrogen 2.819 N/A ARG 177.A N GLU 173.A O no hydrogen 2.693 N/A GLU 178.A N GLU 174.A O no hydrogen 2.842 N/A VAL 179.A N TYR 175.A O no hydrogen 2.931 N/A LEU 180.A N ALA 176.A O no hydrogen 2.956 N/A THR 181.A N ARG 177.A O no hydrogen 2.726 N/A THR 181.A OG1 ARG 177.A O no hydrogen 2.821 N/A ARG 182.A N GLU 178.A O no hydrogen 3.006 N/A ARG 182.A N VAL 179.A O no hydrogen 3.109 N/A ARG 182.A NH1 GLU 178.A OE2 no hydrogen 2.524 N/A LEU 183.A N VAL 179.A O no hydrogen 3.121 N/A LEU 183.A N LEU 180.A O no hydrogen 3.102 N/A ILE 184.A N LEU 180.A O no hydrogen 2.930 N/A